tert-butyl (2S,4E)-4-[(4-ethoxyphenyl)methylidene]-2-(hydroxymethyl)pyrrolidine-1-carboxylate

Systemtic Name: tert-butyl (2S,4E)-4-[(4-ethoxyphenyl)methylidene]-2-(hydroxymethyl)pyrrolidine-1-carboxylate Openeye Name: tert-butyl (2S,4E)-4-[(4-ethoxyphenyl)methylene]-2-(hydroxymethyl)pyrrolidine-1-carboxylate CAS Name: (2S,4E)-4-[(4-ethoxyphenyl)methylidene]-2-(hydroxymethyl)-1-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl (2S,4E)-4-[(4-ethoxyphenyl)methylidene]-2-(hydroxymethyl)pyrrolidine-1-carboxylate Traditional Name: (2S,4E)-4-(4-ethoxybenzylidene)-2-methylol-pyrrolidine-1-carboxylic acid tert-butyl ester Formula: C19H27NO4 MolecularWeight: 333.42198

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C=C2CC(N(C2)C(=O)OC(C)(C)C)CO

Isomeric SMILES

CCOC1=CC=C(C=C1)/C=C/2\C[C@H](N(C2)C(=O)OC(C)(C)C)CO

InChI

InChI=1S/C19H27NO4/c1-5-23-17-8-6-14(7-9-17)10-15-11-16(13-21)20(12-15)18(22)24-19(2,3)4/h6-10,16,21H,5,11-13H2,1-4H3/b15-10+/t16-/m0/s1